Information card for entry 2231932

Structure parameters

• Chemical name: Dichlorido(η^4^-cycloocta-1,5-diene)bis(propanenitrile-κ<i>N</i>)ruthenium(II)
• Formula: C14 H22 Cl2 N2 Ru
• Calculated formula: C14 H22 Cl2 N2 Ru
• SMILES: [CH]12=[CH]3CC[CH]4=[CH](CC1)[Ru]234([N]#CCC)([N]#CCC)(Cl)Cl
• Title of publication: Dichlorido(η^4^-cycloocta-1,5-diene)bis(propanenitrile-κ<i>N</i>)ruthenium(II)
• Authors of publication: Chiririwa, Haleden; Meijboom, Reinout
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 10
• Pages of publication: m1336
• a: 7.593 ± 0.005 Å
• b: 8.8 ± 0.005 Å
• c: 12.658 ± 0.005 Å
• α: 108.156 ± 0.005°
• β: 96.281 ± 0.005°
• γ: 90.536 ± 0.005°
• Cell volume: 798 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0167
• Residual factor for significantly intense reflections: 0.0165
• Weighted residual factors for all reflections included in the refinement: 0.0432
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes